ID: 30913
SMILES:C(=Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)CC21)CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.726
InChIKey:OXAUIMWDFDGCJK-UHFFFAOYSA-N
ID: 30914
SMILES:C1CC(C)CC2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 30915
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(C(CCCCC)O)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.729
InChIKey:VFIYJWMMJRIQMV-UHFFFAOYSA-N
ID: 30916
SMILES:C1CCC(c2c(OC)cc(CCCC)cc2)=C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -15.306
InChIKey:XRMJULNZUYPTEA-UHFFFAOYSA-N
ID: 30917
SMILES:CC1(C)C(=O)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -19.037
InChIKey:WOUJHLUSTPDGBC-UHFFFAOYSA-N
ID: 30918
SMILES:CC(C(O)CC=C(C)C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.446
InChIKey:OUOQXFQTVUXZJA-UHFFFAOYSA-N
ID: 30919
SMILES:C(CCCC)c1cc(O)c2c(c1)C1C(C=CC2)OC(C)(C)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.03
InChIKey:QMEIYJXIOUXCJZ-UHFFFAOYSA-N
ID: 30920
SMILES:CC1=CCCC2C3(C)CC4c5c(cc(CCCCC)cc5OC4(C)C)C3C(=C)C2(C)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.648
CB1 binding score: -10.42
InChIKey:QOIZRZFLKRFODG-UHFFFAOYSA-N
ID: 30921
SMILES:OC1C(=CCOC(C=Cc2ccccc2)=O)C2C(CC1)C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.532
CB1 binding score: -15.519
InChIKey:OBRDTUBOUSUBAG-UHFFFAOYSA-N
ID: 30922
SMILES:c12oc3c(c(C(=O)OC)c(O)cc3)cc(C#C)c1C1C(C2(CCC=C(C)C)C)C(C)(C)OC(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.64
CB1 binding score: -13.867
InChIKey:VIVHODHDWYTRFC-UHFFFAOYSA-N
ID: 30923
SMILES:O=C(C(C)CC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.606
InChIKey:XOMRHMFMQNBCOJ-UHFFFAOYSA-N
ID: 30924
SMILES:c12c(c(OC(=O)C)ccc1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -14.653
InChIKey:LQZDMCLOPWEUHW-UHFFFAOYSA-N
ID: 30925
SMILES:C12C(C)(CC3OC(=O)C(=C)C3C1)C1C(C2)c2c(O)cc(CCCCC)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -16.502
InChIKey:XQIFDWSGBXJSOL-UHFFFAOYSA-N
ID: 30926
SMILES:C(C)(=CC1Oc2c(c(O)cc(CCCCC)c2)C2C=CCC3C(C(C)(C)CC31C)C2)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -17.187
InChIKey:ONQPECQIAQHRJU-UHFFFAOYSA-N
ID: 30927
SMILES:CC1(O)CCC(C(C)C)C(c2c(O)cc(CCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -16.502
InChIKey:ZFFLPNWDXJZOKJ-UHFFFAOYSA-N
ID: 30928
SMILES:Oc1c2c(c(O)cc1)OC(C)(C)C1C2CC(C)(O)C1OC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.357
CB1 binding score: -16.291
InChIKey:ITROTNZKGWKKCC-UHFFFAOYSA-N
ID: 30929
SMILES:C1(C)=CC(C)=C(CC(C)C)C(C(=O)C2(C)Oc3c2c(OC)cc(CCCCC)c3)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.037
InChIKey:WOUYSCBQDFZFCO-UHFFFAOYSA-N
ID: 30930
SMILES:c1(C)c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.527
InChIKey:ADYCLARNGCYRSF-UHFFFAOYSA-N
ID: 30931
SMILES:C(CCCCO)c1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.91
InChIKey:ZYIULORQQXMGIH-UHFFFAOYSA-N
ID: 30932
SMILES:CC12CC3c4c(C)cc(=O)c(C(C)C)cc4OC(C)(C)C1(CC=C(C)C)OC3O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.173
InChIKey:FIQBSOCCWDMTPD-UHFFFAOYSA-N
ID: 30933
SMILES:CC(=CC(CC)C(=CCc1c(O)c(C)cc(OC)c1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -14.993
InChIKey:AXZUPWZUGGTQPC-UHFFFAOYSA-N