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brevetoxin PbTx-3

Molecular formula:C50H72O14
Average mass:897.112
Monoisotopic mass:896.492207
ChemSpider ID:24664676
stereocenter-icon

23 of 23 defined stereocentres

double-bond-stereo-icon

Double-bond stereo

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  • Names down_Arrow
plus-iconless-iconNames and synonyms
Verified

(1S,3R,4aR,5aS,6aR,7Z,9aS,10aR,11aS,12aR,13R,14aS,15aR,16aS,20aR,21aS,22aR,23aS,25aR,26aS,27aR,28aS,29aR,30aS)-1-Hydroxy-3-[2-(hydroxymethyl)-2-propen-1-yl]-9a,13,20,21a,25a,26a,30a-heptamethyl-1,2,3, 4a,5,5a,6a,9,9a,10a,11,11a,12a,13,14,14a,15a,16,16a,20a,21a,22,22a,23a,24,25,25a,26a,27,27a,28a,29,29a,30a-tetratriacontahydro-18H-pyrano[2″,3″:5′,6′]pyrano[2′,3′:5,6]pyrano[3,2-b]pyrano[2′′′′′′,3″ ′′′′:5′′′′′,6′′′′′]pyrano[2′′′′′,3′′′′′:5′′′′,6′′′′]pyrano[2′′′′,3′′′′:6‴,7‴]oxepino[2‴,3‴:6″,7″]oxepino[2″,3″:5′,6′]pyrano[2′,3′:5,6]pyrano[2,3-g]oxocin-18-one

(1S,3R,4aR,5aS,6aR,7Z,9aS,10aR,11aS,12aR,13R,14aS,15aR,16aS,20aR,21aS,22aR,23aS,25aR,26aS,27aR,28aS,29aR,30aS)-1-Hydroxy-3-[2-(hydroxymethyl)-2-propen-1-yl]-9a,13,20,21a,25a,26a,30a-heptamethyl-1,2,3, 4a,5,5a,6a,9,9a,10a,11,11a,12a,13,14,14a,15a,16,16a,20a,21a,22,22a,23a,24,25,25a,26a,27,27a,28a,29,29a,30a-tetratriacontahydro-18H-pyrano[2″,3″:5′,6′]pyrano[2′,3′:5,6]pyrano[3,2-b]pyrano[2′′′′′′,3″ ′′′′:5′′′′′,6′′′′′]pyrano[2′′′′′,3′′′′′:5‴

[ACD/IUPAC Name]

(1S,3R,4aR,5aS,6aR,7Z,9aS,10aR,11aS,12aR,13R,14aS,15aR,16aS,20aR,21aS,22aR,23aS,25aR,26aS,27aR,28aS,29aR,30aS)-1-Hydroxy-3-[2-(hydroxymethyl)-2-propen-1-yl]-9a,13,20,21a,25a,26a,30a-heptamethyl-1,2,3, 4a,5,5a,6a,9,9a,10a,11,11a,12a,13,14,14a,15a,16,16a,20a,21a,22,22a,23a,24,25,25a,26a,27,27a,28a,29,29a,30a-tetratriacontahydro-18H-pyrano[2″,3″:5′,6′]pyrano[2′,3′:5,6]pyrano[3,2-b]pyrano[2′′′′′′,3″ ′′′′:5′′′′′,6′′′′′]pyrano[2′′′′′,3′′′′′:5‴

[German]

[ACD/IUPAC Name]

(1S,3R,4aR,5aS,6aR,7Z,9aS,10aR,11aS,12aR,13R,14aS,15aR,16aS,20aR,21aS,22aR,23aS,25aR,26aS,27aR,28aS,29aR,30aS)-1-Hydroxy-3-[2-(hydroxyméthyl)-2-propén-1-yl]-9a,13,20,21a,25a,26a,30a-heptaméthyl-1,2,3, 4a,5,5a,6a,9,9a,10a,11,11a,12a,13,14,14a,15a,16,16a,20a,21a,22,22a,23a,24,25,25a,26a,27,27a,28a,29,29a,30a-tétratriacontahydro-18H-pyrano[2″,3″:5′,6′]pyrano[2′,3′:5,6]pyrano[3,2-b]pyrano[2′′′′′′,3″ ′′′′:5′′′′′,6′′′′′]pyrano[2′′′′′,3′′′′′:5‴

[French]

[ACD/IUPAC Name]

brevetoxin PbTx-3

Unverified

(1R,3S,5R,7S,9R,11S,12S,14R,16R,18S,20R,21Z,24S,26R,28S,30R,31R,33S,35R,37S,42R,44S,46R,48S)-12-hydroxy-14-[2-(hydroxymethyl)prop-2-enyl]-1,3,11,24,31,41,44-heptamethyl-2,6,10,15,19,25,29,34,38,43,47-undecaoxaundecacyclo[26.22.0.03,26.05,24.07,20.09,18.011,16.030,48.033,46.035,44.037,42]pentaconta-21,40-dien-39-one

42-deoxo-42-hydroxy-brevetoxin B

dihydrobrevetoxin-B (GB-3)

MFCD00214096

[MDL number]
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