ID: 58612
SMILES:c12c(C)c(CCCCC)ccc1CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.367
CB1 binding score: -17.395
InChIKey:SRKKOIZPWDIFNN-UHFFFAOYSA-N
ID: 58613
SMILES:O1c2cc(CCCC)cc(O)c2C2C1(C)CCC1C(C)(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.005
InChIKey:JOCPHCUIWWEBQX-UHFFFAOYSA-N
ID: 58614
SMILES:Oc1cc(CCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 58615
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2ccc(O)c1C=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -18.019
InChIKey:DGXIHJGPLFSNBL-UHFFFAOYSA-N
ID: 58616
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21)N
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 303.402
CB1 binding score: -16.22
InChIKey:QSSICZZEKUUTDE-UHFFFAOYSA-N
ID: 58617
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(C)CC1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.135
InChIKey:QCJUENJHPSPODT-UHFFFAOYSA-N
ID: 58618
SMILES:Cc1c(-c2c(CCCCC)cc(O)c(CC=C(C)CCC=C(C)C)c2)cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.61
CB1 binding score: Not available
InChIKey:YIILRKABDAGGSU-UHFFFAOYSA-N
ID: 58619
SMILES:c12cc(CCCCCC)cc(O)c1OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.476
InChIKey:PWLDAFQGCRJFGZ-UHFFFAOYSA-N
ID: 58620
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 58621
SMILES:C(CC=C(C)C)C(C)=CCc1c(C2Oc3c(c(O)cc(CCCCC)c3)O2)cc(O)c(C(O)=O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.601
CB1 binding score: -15.116
InChIKey:ZHKWXNUNUPMLLA-UHFFFAOYSA-N
ID: 58622
SMILES:C(CCCC)Cc1cc(O)c(C2C=C(C(=O)O)CCC2C(C)C)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.139
InChIKey:RBVWJFQYGQIJSG-UHFFFAOYSA-N
ID: 58623
SMILES:CC(=CCc1c2c(cc(O)c1)OC(C)(C)C1CC=C(C)C(O)C12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.039
InChIKey:NBFZOOPJBDCKCV-UHFFFAOYSA-N
ID: 58624
SMILES:C12c3c(c(CCC(OC(=O)C)C(C)C)c(O)c(C(=O)O)c3O)OC(C)(C)C1CCC(O)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.555
CB1 binding score: -14.331
InChIKey:YVAIGWMHLXCDPO-UHFFFAOYSA-N
ID: 58625
SMILES:c1c(O)c2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.145
InChIKey:YJSPCCRFFZMYHY-UHFFFAOYSA-N
ID: 58626
SMILES:C(Cc1cc(C2C=C(C)CCC2C(=C)C)c(O)c(O)c1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.364
InChIKey:GSPLFILKQXXBKL-UHFFFAOYSA-N
ID: 58627
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 58628
SMILES:CC(C)=CCc1cc2c(cc1C)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 310.481
CB1 binding score: -15.93
InChIKey:PBLZGRQHGWZIPS-UHFFFAOYSA-N
ID: 58629
SMILES:CC1=C2C3=C(CC(C)(C)C3)C(C)(Oc3c2c(O)cc(CCC)c3)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -14.58
InChIKey:UDEIFRFBZCTBBV-UHFFFAOYSA-N
ID: 58630
SMILES:C(CCC(c1cc(O)c(C2C(C(C)=C)CCC(C)C2)c(O)c1)CCCC)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.647
CB1 binding score: -16.625
InChIKey:GMBIOSGLAARSNU-UHFFFAOYSA-N
ID: 58631
SMILES:c1(O)cc2c(c(OC)c1OC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.54
InChIKey:FZCFKFURBOLPDI-UHFFFAOYSA-N
ID: 58632
SMILES:O=C(C)OC1C(OC(C)=O)C2=C(C(C)(CC=C(C)C)OC2=O)Oc2c1c(O)cc(CCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.507
CB1 binding score: -13.951
InChIKey:HMEOINXNLGTYIX-UHFFFAOYSA-N