(Q105244497)

English

(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(17-hydroxy-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosan-20-yl)oxy]oxane-3,4,5-triol

group of stereoisomers with the chemical formula C₃₃H₅₅NO₇

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Statements

instance of

group of stereoisomers

0 references

1 reference

577.3978531 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₃H₅₅NO₇

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canonical SMILES

OCC1OC(OC2CCC3(C)C(C2)C(O)CC4C5CCC6C(C)C7N(CC(C)CC7)CC6C5CC43)C(O)C(O)C1O

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isomeric SMILES

CC1CCC2C(C)C3CCC4C(CC5C4CC(O)C4CC(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CCC45C)C3CN2C1

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found in taxon

Fritillaria hupehensis

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stated in

Characterizing distribution of steroidal alkaloids in Fritillaria spp. and related compound formulas by liquid chromatography-mass spectrometry combined with hierarchial cluster analysis

Fritillaria monantha

1 reference

stated in

Characterizing distribution of steroidal alkaloids in Fritillaria spp. and related compound formulas by liquid chromatography-mass spectrometry combined with hierarchial cluster analysis

Identifiers

InChI

InChI=1S/C33H55NO7/c1-16-4-7-26-17(2)19-5-6-20-21(23(19)14-34(26)13-16)11-24-22(20)12-27(36)25-10-18(8-9-33(24,25)3)40-32-31(39)30(38)29(37)28(15-35)41-32/h16-32,35-39H,4-15H2,1-3H3/t16?,17?,18?,19?,20?,21?,22?,23?,24?,25?,26?,27?,28-,29-,30+,31-,32-,33?/m1/s1

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InChIKey

RRZZOQYXEGRKNH-VHUKGLNMSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RRZZOQYXEGRKNH-VHUKGLNMSA-N

1 reference

(Q105244497)

(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(17-hydroxy-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosan-20-yl)oxy]oxane-3,4,5-triol

Statements

Identifiers

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