Try beta.chemspider
- 7 of 7 defined stereocentres
(1S,1'S,2'R,3'R,11'S,12'S,14'R)-5',6,12'-Trihydroxy-6',7-dimethoxy-7',21',30'-trimethyl-27'-oxo-3,4-dihydro-2H-spiro[isoquinoline-1,26'-[17,19,28]trioxa[24]thia[13,30]diazaheptacyclo[12.9.6.1~3,11~.0~ 2,13~.0~4,9~.0~15,23~.0~16,20~]triaconta[4,6,8,15,20,22]hexaen]-22'-yl acetate
O=C(Oc1c(c9OCOc9c4c1[C@@H]8SC[C@]3(c2cc(OC)c(O)cc2CCN3)C(=O)OC[C@@H]4N7[C@@H](O)[C@H]6N(C)[C@H](c5c(O)c(OC)c(cc5C6)C)[C@@H]78)C)C
InChI=1S/C39H43N3O11S/c1-16-9-20-10-22-37(46)42-23-13-50-38(47)39(21-12-25(48-5)24(44)11-19(21)7-8-40-39)14-54-36(30(42)29(41(22)4)26(20)31(45)32(16)49-6)28-27(23)35-34(51-15-52-35)17(2)33(28)53-18(3)43/h9,11-12,22-23,29-30,36-37,40,44-46H,7-8,10,13-15H2,1-6H3/t22-,23-,29+,30+,36-,37-,39-/m0/s1
PKVRCIRHQMSYJX-OKCAXSANSA-N
CSID:8660684, http://www.chemspider.com/Chemical-Structure.8660684.html (accessed 17:16, Apr 27, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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