Molecular formula: | C50H70O14 |
Average mass: | 895.096 |
Monoisotopic mass: | 894.476557 |
ChemSpider ID: | 9041149 |
23 of 23 defined stereocentres
Double-bond stereo
2-{[(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-9a,13,20,21a,25a,26a,30a-heptamethyl-18-oxo-2,3,4a,5,5a,6a,9,9a,10a,11,11a, 12a,13,14,14a,15a,16,16a,18,20a,21a,22,22a,23a,24,25,25a,26a,27,27a,28a,29,29a,30a-tetratriacontahydro-1H-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-3-yl]methyl}acrylaldehyde
79580-28-2
[RN]Brevetoxin B
brevetoxin-B
2-[[(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-1,3,11,24,31,41,44-heptamethyl-39-oxo-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-14-yl]methyl]prop-2-enal
BREVETOXIN PBTX-2, PTYCHODISCUS BREVIS
MFCD00214092
[MDL number]