ID: 83581
SMILES:C(c1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.253
InChIKey:YQZKSASIODXUPT-UHFFFAOYSA-N
ID: 83582
SMILES:O1C(=O)C2=CC(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -12.98
InChIKey:OQRIPIYEJOXOPD-UHFFFAOYSA-N
ID: 83583
SMILES:C(=CCCC1(C)Oc2c(c(O)cc(CCCCCC)c2)C2CC(C)(O)CCC12)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -16.431
InChIKey:UPHQZAZBSKBNTA-UHFFFAOYSA-N
ID: 83584
SMILES:C(Cc1cc(O)c(C2C(C(C)(C)O)CCC(C)=C2)c(O)c1)=CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.229
InChIKey:GLTHSWGRKFHTQN-UHFFFAOYSA-N
ID: 83585
SMILES:C(C)(=CCCc1c(-c2c(O)c(=O)c3c(c(CCCCC)cc(O)c3)c(O)c2C)OC(C)(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -15.162
InChIKey:ZXWQGGYJXRLZOW-UHFFFAOYSA-N
ID: 83586
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 83587
SMILES:CCCCCc1cc2c(c(O)c1)C1=C(C(C)(CCC=C(C)C)C=C)CC(OC(=O)C)C2(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -14.652
InChIKey:PEZBWAUGBIWDFA-UHFFFAOYSA-N
ID: 83588
SMILES:O(C(=O)C)CC1C(O)c2cc3c(cc2CCC(O)C(=C)C)OC(C)(C)C(O)C13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -16.526
InChIKey:WWHPHINAFSNZSF-UHFFFAOYSA-N
ID: 83589
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C)(C)C1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.552
CB1 binding score: -12.85
InChIKey:XIFFHILSFSWENF-UHFFFAOYSA-N
ID: 83590
SMILES:C1(C)CCC2c3c(cc(CCCCC)cc3O1)OC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -15.94
InChIKey:DGROGBDXJAVJHR-UHFFFAOYSA-N
ID: 83591
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(=O)C(OC)=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.735
InChIKey:WLFURTLLNPKYHB-UHFFFAOYSA-N
ID: 83592
SMILES:CC1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC1CC(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.608
InChIKey:HFCXGRSFFJCQHM-UHFFFAOYSA-N
ID: 83593
SMILES:c1cc(-c2cc(O)c3c(c2)OC(C)(C)C2C3C=C(C=CC=C(C)CCC=C(C)C)CC2)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.653
CB1 binding score: -14.605
InChIKey:KISIMKLMXVUZJT-UHFFFAOYSA-N
ID: 83594
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.329
InChIKey:OGTYERSWJNGKFK-UHFFFAOYSA-N
ID: 83595
SMILES:O=C(c1cc(OC)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.721
InChIKey:KOBOECKMSIGNHJ-UHFFFAOYSA-N
ID: 83596
SMILES:c1c2c(cc(CCCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -17.852
InChIKey:KTVUXMGMEPPINC-UHFFFAOYSA-N
ID: 83597
SMILES:C1C2(C)C(C(C)CCc3cc(OC(=O)C)cc(O)c3)(C(C)CC2)C(=O)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.862
InChIKey:IBQQFOGPJDLFFX-UHFFFAOYSA-N
ID: 83598
SMILES:C1C2C(C)(C)Oc3c(cccc3O)C2C(O)C(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -15.067
InChIKey:SBQMONKJZUJRQO-UHFFFAOYSA-N
ID: 83599
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 83600
SMILES:CC1=CC(c2c(CCCCC)cc3c(c2O)C2C=C(C)C(O)CC2C(C)(C)O3)(CC=C(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -15.545
InChIKey:YHYNVPQDWFZYIH-UHFFFAOYSA-N
ID: 83601
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)O)CC1)CC(CCCC(C)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -13.978
InChIKey:CTEPFBKQDXCPMA-UHFFFAOYSA-N