Flaccidin B
Molecular Formula:
C41H66O12
InChI: InChI=1/C41H66O12/c1-36(2)14-16-41(35(48)49)17-15-39(6)21(22(41)18-36)8-9-26-38(5)12-11-27(37(3,4)25(38)10-13-40(26,39)7)52-34-32(28(44)23(43)20-50-34)53-33-31(47)30(46)29(45)24(19-42)51-33/h8,22-34,42-47H,9-20H2,1-7H3,(H,48,49)/t22u,23?,24u,25u,26u,27-,28?,29?,30?,31?,32?,33?,34?,38-,39u,40+,41-/m0/s1/f/h48H
InChIKey: InChIKey=GXWUEMSASMVWKO-UOLZQTHLDT
SMILES: CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)O)C
Names:
Flaccidin B
NSC626094
(4aS,6bR,10S,12aS)-10-[4,5-dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-oxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Registries:
PubChem CID 362350
PubChem ID 8142091
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