ID: 50653
SMILES:C(C)CCCc1cc(OC)c2c(c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.752
InChIKey:OGYWTOWBLOTCHL-UHFFFAOYSA-N
ID: 50654
SMILES:C1c2c(O)cc(CCCCC)cc2OC(CC=C(C)C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.91
InChIKey:XVOOASSZPRAHGC-UHFFFAOYSA-N
ID: 50655
SMILES:C1CC(CO)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.33
InChIKey:NCJDWASJJXZUDN-UHFFFAOYSA-N
ID: 50656
SMILES:C(C)CCCC(C)c1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.942
InChIKey:OJOLWLDCDPMLHW-UHFFFAOYSA-N
ID: 50657
SMILES:CC1=CC2Oc3c(c(O)cc(CCCCC)c3)C2C2C(CC1)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.147
InChIKey:DSDJDQSTXSAYEV-UHFFFAOYSA-N
ID: 50658
SMILES:c12ccc(O)cc1OC(C)(C)C1C2CC(C)=CCCC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.866
InChIKey:VAEQPIWRMZPUIS-UHFFFAOYSA-N
ID: 50659
SMILES:c12c(cc(CCCCC)cc1O)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: 50660
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CC12)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.868
InChIKey:YFHOFGSUSPSPHT-UHFFFAOYSA-N
ID: 50661
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(c(O)cc3C)C2)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.132
InChIKey:FFRLODDZVQQCDT-UHFFFAOYSA-N
ID: 50662
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)c1cc(OC)c3c(c21)C(=O)C=C1C2C(C(C)(C)CCC2)C3O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.678
CB1 binding score: -11.442
InChIKey:PSQMIQYBWMVYOC-UHFFFAOYSA-N
ID: 50663
SMILES:O=C(c1c2c(c(O)cc1C(C)C)OC(C)(C)C1CCC(C)=CC12)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -13.988
InChIKey:WGLRQQJVAFKNGA-UHFFFAOYSA-N
ID: 50664
SMILES:Cc1cc2c(cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.842
InChIKey:ALXZHGACBCVUPW-UHFFFAOYSA-N
ID: 50665
SMILES:c1(CO)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.441
InChIKey:UKTGXEQHQBLPRE-UHFFFAOYSA-N
ID: 50666
SMILES:C1(C)(C)C2=C(C(O)CC(O)(C)C2=O)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.793
InChIKey:OYBWRFSBSODYKO-UHFFFAOYSA-N
ID: 50667
SMILES:CC1(C)Oc2c(c(OC)cc(C(OC)=O)c2)C2C1CC=C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.015
InChIKey:DPZURACVGYOCDS-UHFFFAOYSA-N
ID: 50668
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 50669
SMILES:C1=C(C)CCC2OC2(C)CCC2C(C)(C)Oc3c(c(OC)cc(CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.398
InChIKey:KVHYJPRPKHSDHI-UHFFFAOYSA-N
ID: 50670
SMILES:O=C(C)OC1CC(=C)C2(O)C(=C(C)CC3c4c(O)cc(CCCCC)cc4O3)C2C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -14.109
InChIKey:IXLWMZXDPXTCKX-UHFFFAOYSA-N
ID: 50671
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 50672
SMILES:CC12C(O)CC(C(=O)O)=CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: Not available
InChIKey:KLXJLJUWPSBORW-UHFFFAOYSA-N
ID: 50673
SMILES:C1(CCCC=CCC)=CC(=O)C2=C(C1=O)OC1(C)C2CC(=C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.658
InChIKey:XYFDNZCNMPYLIX-UHFFFAOYSA-N