ID: 97483
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(CCC=C(C)CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 97484
SMILES:Oc1c(C=O)c(CCCCC)c2c(c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.204
InChIKey:IBTUGIFZXPLXRL-UHFFFAOYSA-N
ID: 97485
SMILES:O=S(=O)(OCC(C1CCC(C)=CC1c1c(O)c(C(O)=O)c(CCCCC)cc1O)=O)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.513
CB1 binding score: -16.293
InChIKey:ZLCUTSNFVCTFNX-UHFFFAOYSA-N
ID: 97486
SMILES:C(C=C(C)C(=O)O)CC(=CCc1c(OC)cc(CCCCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.705
InChIKey:YKUNZXHVAIWLLV-UHFFFAOYSA-N
ID: 97487
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)O)CCC2C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.633
InChIKey:FZWYBAOKWLZCKC-UHFFFAOYSA-N
ID: 97488
SMILES:Cc1c(COc2c(C(C)C)ccc(C)c2)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -15.763
InChIKey:DDIAKAOTBNTGOX-UHFFFAOYSA-N
ID: 97489
SMILES:C(CCCCCCCCCC)CCCCC(OCc1cc(OC)c(C2C=C(C)CCC2C(=C)C)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.802
CB1 binding score: -15.669
InChIKey:CKJSQRBFLKNUNT-UHFFFAOYSA-N
ID: 97490
SMILES:Oc1cccc2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.066
InChIKey:XZPWDDDJDIXCIE-UHFFFAOYSA-N
ID: 97491
SMILES:C1(C)(C)C2C(CC(O)(C)CC2)c2c(cc(CCCCC)c(C(O)=O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.123
InChIKey:VSZQEUYHLCIKBY-UHFFFAOYSA-N
ID: 97492
SMILES:CC=C(C)C(=O)Oc1cc(C)c(C=O)c(C2C=C(C)CCC2C(=C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -15.148
InChIKey:ORCQVMJSFKNCRK-UHFFFAOYSA-N
ID: 97493
SMILES:Oc1cc(CCCC)cc2c1C1(OC(CC=C(C)C)C1(C)C)C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -14.222
InChIKey:BSLXJSXCLNGQBA-UHFFFAOYSA-N
ID: 97494
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 97495
SMILES:CC1(C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.27
InChIKey:JNUWKSNIBRJTBP-UHFFFAOYSA-N
ID: 97496
SMILES:O=CC1(C)Oc2c(c(OC)cc(CCCCC)c2)C2C=C(C(O)=O)CCC12O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -14.193
InChIKey:RGWNGHPSDUZHQW-UHFFFAOYSA-N
ID: 97497
SMILES:C1(COC)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.881
InChIKey:PQZMQHVIZFPKQU-UHFFFAOYSA-N
ID: 97498
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)(O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 97499
SMILES:CC(=C1C2C3C(C)(CC(=O)C=C3C)CC(=O)C23CC1(C(=O)O)Oc1cc(CCC(=O)NCCNC)cc(O)c13)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 550.652
CB1 binding score: -15.537
InChIKey:GUWSGQFMQHMMKL-UHFFFAOYSA-N
ID: 97500
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(O)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 97501
SMILES:C12C(C)CCC1C1(CBr)Oc3c4c(cc(C)c3)OC(C)(C)C3C2C=C(C)C(CC3)C41
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 471.479
CB1 binding score: -12.496
InChIKey:FYTZABFXMWYHFX-UHFFFAOYSA-N
ID: 97502
SMILES:CC1(O)CCC(C(=C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.963
InChIKey:DSNZBTMPMQRYNQ-UHFFFAOYSA-N
ID: 97503
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N