ID: 52396
SMILES:C(CCc1c2c(c(O)cc1C(CCC)=O)OC(C)(C)C1C2C=C(C)CC1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.284
InChIKey:NZQSQTFZAYKIDG-UHFFFAOYSA-N
ID: 52397
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 52398
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)C1CC2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -17.14
InChIKey:CCXKRTYLJFZCPS-UHFFFAOYSA-N
ID: 52399
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCCC)c3)C3CC2C(C=C3O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -13.376
InChIKey:QYEXBTGOUSOSJN-UHFFFAOYSA-N
ID: 52400
SMILES:CC1=CCCC2(C)Oc3c(c(O)cc(CCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.821
InChIKey:CYFBFAUXXAFRHW-UHFFFAOYSA-N
ID: 52401
SMILES:c1(OC)cc(CCCCC)c(OC)cc1OCC1OC(C(C)(O)C)CC1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.617
CB1 binding score: -11.814
InChIKey:GEASKWZQFULYDU-UHFFFAOYSA-N
ID: 52402
SMILES:C(c1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2)=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -11.842
InChIKey:PAPHINIYHOYKLP-UHFFFAOYSA-N
ID: 52403
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCCC)c3C=O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.22
InChIKey:RKOAZPPRSPCDJJ-UHFFFAOYSA-N
ID: 52404
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C)(C)C3CC(C)=CCC31C(=O)c1c(O)c(CC(C(O)(C)C)O)c(O)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 564.719
CB1 binding score: -13.522
InChIKey:MYNVTNSIWRGCMB-UHFFFAOYSA-N
ID: 52405
SMILES:C(CCCCc1cc(O)c(C2C=C(CCC=C(C)C)C(O)CC2C)o1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -11.868
InChIKey:SJAXZTACUIAZMM-UHFFFAOYSA-N
ID: 52406
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C3(O)C(C)(CC2(O)O1)CC(CC=C(C)C)C(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -15.669
InChIKey:KQNKSRLPLOERFJ-UHFFFAOYSA-N
ID: 52407
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C(C)(CCC=C(C)C)O1)O2)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.071
InChIKey:IWWWCZMBRDJPFX-UHFFFAOYSA-N
ID: 52408
SMILES:C(c1c(O)c2c(cc1O)OC(C)(C)C1C2CC(C)=CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.887
InChIKey:MGJXLEJRYNCZIV-UHFFFAOYSA-N
ID: 52409
SMILES:C1=CC2C(C)CC=CC(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -12.355
InChIKey:VUYQGJVNFRBBPX-UHFFFAOYSA-N
ID: 52410
SMILES:Cc1c(O)c(C)c2c(c1C(O)=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.083
InChIKey:AWATVXPEUKSUPU-UHFFFAOYSA-N
ID: 52411
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 52412
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 52413
SMILES:C(=CCc1cc(C2C=C(C)CCC2C(C)=C)ccc1O)=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.584
CB1 binding score: -16.79
InChIKey:XPUKGBXLHFEPGE-UHFFFAOYSA-N
ID: 52414
SMILES:c1(CCCC)c(CCCCC)cc(O)c2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.477
InChIKey:QLUGJXOCTAFDMA-UHFFFAOYSA-N
ID: 52415
SMILES:O1c2c(c(=O)cc(CCCCC)cc2O)C2C=C(C)C(=O)C(O)C2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -14.677
InChIKey:FUPOKDCHSKATQU-UHFFFAOYSA-N
ID: 52416
SMILES:c1c(OC)cc(-c2c(O)c(C3C=C(C)CCC3C(=C)C)cc(CO)c2C)c(CC=C(C)CCC=C(C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.749
CB1 binding score: -14.203
InChIKey:YOYBQJNKCYABCH-UHFFFAOYSA-N