Vitas-M small molecule compound

(3R,6R,7S,8S,10R,11R,12R,13S,16S,17R)-8-tert-butyl-6,12,17-trihydroxy-16-methyl-2,4,14,19-tetraoxahexacyclo[8.7.2.0^{1,11}.0^{3,7}.0^{7,11}.0^{13,17}]nonadecane-5,15,18-trione

Catalog ID
STL565717
SMILES O=C1O[C@@H]2[C@@]([C@@H]1C)(O)[C@@]13[C@]4([C@H]2O)[C@@H](OC3=O)C[C@H]([C@@]24[C@H](O1)OC(=O)[C@@H]2O)C(C)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H24O10 MW 424.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24O10/c1-6-12(23)28-11-9(21)18-8-5-7(16(2,3)4)17(18)10(22)13(24)29-15(17)30-20(18,14(25)27-8)19(6,11)26/h6-11,15,21-22,26H,5H2,1-4H3/t6-,7+,8-,9+,10+,11+,15+,17+,18+,19-,20-/m1/s1
InChIKey
SQOJOAFXDQDRGF-MMQTXUMRSA-N
Synonyms
15291-77-7
(1R3R6R7S8S10R11R12R13S16S17R)8tertbutyl61217trihydroxy16methyl241419tetraoxahexacyclo(8720111037071101317)nonadecane51518trione
(3R6R7S8S10R11R12R13S16S17R)8tertbutyl61217trihydroxy16methyl241419tetraoxahexacyclo(8720^(111)0^(37)0^(711)0^(1317))nonadecane51518trione
15291777
6324617
GINKGOLIDEB
GINKGOLIDEB(S)
GINKGOLIDEBANALYTICALSTANDARD
GINKGOLIDEBFROMGINKGOBILOBALEAVES90(HPLC)
InChI=1SC20H24O10c1612(23)28119(21)18857(16(23)4)17(18)10(22)13(24)2915(17)3020(1814(25)278)19(611)26h61115212226H5H214H3t67+89+10+11+15+17+18+1920m1s1
MFCD05662347
O=C1O(C@@H)2(C@@)((C@@H)1C)(O)(C@@)13(C@)4((C@H)2O)(C@H)(OC3=O)C(C@H)((C@@)24(C@H)(O1)OC(=O)(C@@H)2O)C(C)(C)C
ZINC000008552017

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.