(Q105202142)

English

[(2S,5S,10R,13R,14R,17S,18S)-4-ethyl-13,14-dihydroxy-10-methyl-6-oxa-4-azaheptacyclo[15.2.1.02,7.02,11.03,13.05,10.014,19]icosan-18-yl] (Z)-3-phenylprop-2-enoate

group of stereoisomers with the chemical formula C₃₀H₃₇NO₅

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Statements

instance of

group of stereoisomers

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1 reference

491.267173284 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₀H₃₇NO₅

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canonical SMILES

O=C(OC1C2CCC3(O)C1C(C2)C45C6OC7N(CC)C5C3(O)CC4C7(C)CC6)C=CC=8C=CC=CC8

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isomeric SMILES

CCN1C2[C@@]34C5CC[C@](C)(C3C[C@]2(O)[C@@]2(O)CC[C@H]3CC4C2[C@H]3OC(=O)/C=C\c2ccccc2)[C@@H]1O5

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found in taxon

Delphinium cossonianum

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stated in

Three diterpenoid alkaloids from Delphinium cossonianum

Identifiers

InChI

InChI=1S/C30H37NO5/c1-3-31-25-29(34)16-20-27(2)13-12-21(35-26(27)31)30(20,25)19-15-18-11-14-28(29,33)23(19)24(18)36-22(32)10-9-17-7-5-4-6-8-17/h4-10,18-21,23-26,33-34H,3,11-16H2,1-2H3/b10-9-/t18-,19?,20?,21?,23?,24-,25?,26-,27+,28+,29+,30+/m0/s1

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InChIKey

OWNAHFPYWRUSLG-OPDIYQCCSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OWNAHFPYWRUSLG-OPDIYQCCSA-N

(Q105202142)

[(2S,5S,10R,13R,14R,17S,18S)-4-ethyl-13,14-dihydroxy-10-methyl-6-oxa-4-azaheptacyclo[15.2.1.02,7.02,11.03,13.05,10.014,19]icosan-18-yl] (Z)-3-phenylprop-2-enoate

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Identifiers

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