(Q105166176)

English

(1R,3R,4R,5R,6R,8S,19R)-3-chloro-4-ethenyl-4,9,9,20,20-pentamethyl-5-(methylideneamino)-7-oxa-11-azahexacyclo[14.3.1.05,19.06,8.010,18.012,17]icosa-10(18),12,14,16-tetraen-19-ol

chemical compound

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instance of

type of chemical entity

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subclass of

3-Chloro-4-ethenyl-4,9,9,20,20-pentamethyl-5-(methylideneamino)-7-oxa-11-azahexacyclo[14.3.1.05,19.06,8.010,18.012,17]icosa-10(18),12,14,16-tetraen-19-ol

1 reference

based on heuristic

inferred from SMILES

mass

438.207405912 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₁ClN₂O₂

0 references

canonical SMILES

ClC1CC2C3(O)C=4C=5C(=CC=CC5C2(C)C)NC4C(C)(C)C6OC6C3(N=C)C1(C=C)C

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isomeric SMILES

C=C[C@@]1(C)[C@H](Cl)C[C@@H]2C(C)(C)c3cccc4[nH]c5c(c34)[C@@]2(O)[C@]1(N=C)[C@H]1O[C@H]1C5(C)C

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found in taxon

Hapalosiphon delicatulus

1 reference

stated in

Isolation of a nitrile-containing indole alkaloid from the terrestrial blue-green alga hapalosiphon delicatulus

Identifiers

InChI

InChI=1S/C26H31ClN2O2/c1-8-24(6)16(27)12-15-22(2,3)13-10-9-11-14-17(13)18-19(29-14)23(4,5)20-21(31-20)26(24,28-7)25(15,18)30/h8-11,15-16,20-21,29-30H,1,7,12H2,2-6H3/t15-,16-,20-,21+,24+,25-,26+/m1/s1

0 references

InChIKey

MKRVHEXNGFBKJC-CXGOSFSJSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MKRVHEXNGFBKJC-CXGOSFSJSA-N

(Q105166176)

(1R,3R,4R,5R,6R,8S,19R)-3-chloro-4-ethenyl-4,9,9,20,20-pentamethyl-5-(methylideneamino)-7-oxa-11-azahexacyclo[14.3.1.05,19.06,8.010,18.012,17]icosa-10(18),12,14,16-tetraen-19-ol

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