ID: 34567
SMILES:C1(=O)C(C=O)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -17.653
InChIKey:PHZKWLRIKPBGGS-UHFFFAOYSA-N
ID: 34568
SMILES:C(c1c(O)c2c(cc1O)OC(C)(C)C1CCC(C)C(=O)C21)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.367
InChIKey:JILGSSNRMSXMDU-UHFFFAOYSA-N
ID: 34569
SMILES:Cc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -18.174
InChIKey:KFCSDBGFJFKYQA-UHFFFAOYSA-N
ID: 34570
SMILES:c1c(C)cc2c(c1O)-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -17.792
InChIKey:CYTXEQAJNPZCEA-UHFFFAOYSA-N
ID: 34571
SMILES:O=C(c1cccc2c1C(=O)C1C(C(C)(CCC=C(C)C)C2)Oc2c1c(O)cc(CCC)c2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.559
CB1 binding score: -15.886
InChIKey:OAZGDJOKWIIZCN-UHFFFAOYSA-N
ID: 34572
SMILES:c12cc(CCCC)ccc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -16.055
InChIKey:FGVCTSCNLYKIAY-UHFFFAOYSA-N
ID: 34573
SMILES:C1C(C(=C)C)(O)CC2C(=C)Oc3c(c(O)cc(CCCCC)c3)C2=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.604
InChIKey:ZFHIVKFBCFTFTI-UHFFFAOYSA-N
ID: 34574
SMILES:O(C)C(=O)CCC1C2C(C(C)(C)Oc3cc(CCC)cc(O)c32)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.511
InChIKey:VTRSRWGPPXDXFL-UHFFFAOYSA-N
ID: 34575
SMILES:C1C2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 34576
SMILES:C1(C)(C)C2C(c3c(O)cc(CCCCC)cc3O1)CC(C(O)=O)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.256
InChIKey:BSTSDOUWRKYSFT-UHFFFAOYSA-N
ID: 34577
SMILES:C1(C(O)(C)C)Oc2c(c(OC)cc(CCCCC)c2)C2CC(=C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -13.658
InChIKey:RCMVAJPYLGVZCU-UHFFFAOYSA-N
ID: 34578
SMILES:O(C)c1c(OCCCCC)cc2c3c1OC(C)(C)C1C3C(C(C)(C)OO2)CCC1(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.573
CB1 binding score: -13.708
InChIKey:QSZXGJNAOHYGJP-UHFFFAOYSA-N
ID: 34579
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCCC)c3)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.058
InChIKey:UXOBYFHCQYPOAT-UHFFFAOYSA-N
ID: 34580
SMILES:C1(C(C)C)C(OC(C(C)CC)c2c(C)c(O)cc(CCCCC)c2)=C2OC(C)(C)C3CCC(C)C13O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.748
CB1 binding score: -14.465
InChIKey:UKGZOHOBBQEGRF-UHFFFAOYSA-N
ID: 34581
SMILES:C(C)(C)C1CC=C(C)C(=O)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.38
InChIKey:GUIDIBWECSMDDB-UHFFFAOYSA-N
ID: 34582
SMILES:CC1=C(C)C(CC(C)=CCc2cc(O)cc(C)c2O)C(OC)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -11.938
InChIKey:BOYOGVHAVYDUMD-UHFFFAOYSA-N
ID: 34583
SMILES:O1c2c(c(O)cc(CCCCC)c2)-c2c(c(O)c(OC)c(C)c2)-c12C(C=C(C)C)C(=O)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.601
CB1 binding score: -15.452
InChIKey:CNPCNIDKUVULOV-UHFFFAOYSA-N
ID: 34584
SMILES:C(C(C)=CCc1cc(O)cc(C)c1O)CCC(C(=O)O)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -18.103
InChIKey:VPYZIKLWEKNSNY-UHFFFAOYSA-N
ID: 34585
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 34586
SMILES:c1(O)c2c(c(C)c(C(C)C(CC)C)c1)C=CC(CCC=C(C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.101
InChIKey:LYBJIGWAVHRDAQ-UHFFFAOYSA-N
ID: 34587
SMILES:C(COc1c2c(cc(CCCCC)c1O)OC(C)(C)C1C(C=C(C=CC=C(C)C)C)CCC21O)(O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 538.769
CB1 binding score: -15.42
InChIKey:RABAJKAJZJFKLT-UHFFFAOYSA-N