(Q110078600)

English

2-[[3,12-dihydroxy-17-(6-hydroxy-6-methylhept-2-en-2-yl)-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

group of stereoisomers with the chemical formula C₃₆H₆₂O₉

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

638.439383564 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₆₂O₉

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canonical SMILES

OCC1OC(OC2CC3(C)C(CC(O)C4C(C(=CCCC(O)(C)C)C)CCC43C)C5(C)CCC(O)C(C)(C)C25)C(O)C(O)C1O

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found in taxon

Panax

1 reference

stated in

Phytochemical and analytical studies of Panax notoginseng (Burk.) F.H. Chen

Identifiers

InChI

InChI=1S/C36H62O9/c1-19(10-9-13-32(2,3)43)20-11-15-35(7)26(20)21(38)16-24-34(6)14-12-25(39)33(4,5)30(34)22(17-36(24,35)8)44-31-29(42)28(41)27(40)23(18-37)45-31/h10,20-31,37-43H,9,11-18H2,1-8H3

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InChIKey

SLPPUMWTJMNBCW-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

SLPPUMWTJMNBCW-UHFFFAOYSA-N

(Q110078600)

2-[[3,12-dihydroxy-17-(6-hydroxy-6-methylhept-2-en-2-yl)-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

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Identifiers

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