(Q105285950)

English

[(1S,3R,5S,6R,7S,8R,9R,10R,13S,17R)-6,7-diacetyloxy-17-(furan-3-yl)-1-hydroxy-4,4,8,10,13-pentamethyl-2,3,5,6,7,9,11,12,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

556.303618368 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₄₄O₈

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canonical SMILES

O=C(OC1C(OC(=O)C)C2(C3=CCC(C4=COC=C4)C3(C)CCC2C5(C)C(O)CC(OC(=O)C)C(C)(C)C15)C)C

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isomeric SMILES

CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@H]2C(C)(C)[C@H](OC(C)=O)C[C@H](O)[C@]2(C)[C@H]2CC[C@]3(C)C(=CC[C@H]3c3ccoc3)[C@]12C

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found in taxon

Munronia pinnata

1 reference

stated in

Bioactive Limonoid Constituents of Munronia henryi

Identifiers

InChI

InChI=1S/C32H44O8/c1-17(33)38-25-15-24(36)32(8)23-11-13-30(6)21(20-12-14-37-16-20)9-10-22(30)31(23,7)28(40-19(3)35)26(39-18(2)34)27(32)29(25,4)5/h10,12,14,16,21,23-28,36H,9,11,13,15H2,1-8H3/t21-,23-,24-,25+,26+,27-,28+,30-,31-,32-/m0/s1

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InChIKey

VGPRFELQIPNZRN-RHSQWIFZSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VGPRFELQIPNZRN-RHSQWIFZSA-N

1 reference

(Q105285950)

[(1S,3R,5S,6R,7S,8R,9R,10R,13S,17R)-6,7-diacetyloxy-17-(furan-3-yl)-1-hydroxy-4,4,8,10,13-pentamethyl-2,3,5,6,7,9,11,12,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

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Identifiers

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