(Q105181097)

English

3-[[12-Acetyloxy-17-[5-(2-hydroxypropan-2-yl)oxolan-2-yl]-4,4,8,10,13,14-hexamethyl-1,2,3,5,6,7,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-3-oxopropanoic acid

group of stereoisomers with the chemical formula C₃₅H₅₆O₈

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

604.397518752 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₅H₅₆O₈

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canonical SMILES

O=C(OC1CC2C3(C)CCC(OC(=O)CC(=O)O)C(C)(C)C3CCC2(C)C4(C)CCC(C5OC(CC5)C(O)(C)C)C14C)C

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found in taxon

Betula glandulosa

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stated in

Triterpenoids from the leaves of the siberian species of birchBetula nana andB. exilis

Identifiers

InChI

InChI=1S/C35H56O8/c1-20(36)41-27-18-24-32(6)15-14-25(43-29(39)19-28(37)38)30(2,3)23(32)13-16-33(24,7)34(8)17-12-21(35(27,34)9)22-10-11-26(42-22)31(4,5)40/h21-27,40H,10-19H2,1-9H3,(H,37,38)

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InChIKey

NKTTWQUNRUHARF-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NKTTWQUNRUHARF-UHFFFAOYSA-N

(Q105181097)

3-[[12-Acetyloxy-17-[5-(2-hydroxypropan-2-yl)oxolan-2-yl]-4,4,8,10,13,14-hexamethyl-1,2,3,5,6,7,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-3-oxopropanoic acid

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Identifiers

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