ID: 83308
SMILES:C1(C)CCC2C(C)(C)Oc3c(c(OC)cc(CCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.502
InChIKey:KJDRUZHWJRXWOJ-UHFFFAOYSA-N
ID: 83309
SMILES:c1(O)c(C(=O)C(C)C)c2c(c(O)c1)C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.406
CB1 binding score: -16.216
InChIKey:BIHNZVKFYYLTFH-UHFFFAOYSA-N
ID: 83310
SMILES:CC(C)C1(Oc2cc(CCCCC)cc(O)c2)C=CC(OO)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.74
InChIKey:AABDQWYQLFQLEX-UHFFFAOYSA-N
ID: 83311
SMILES:o1c(CCCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.496
InChIKey:YFDZZYBMGPHHKQ-UHFFFAOYSA-N
ID: 83312
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 83313
SMILES:c12cc(C)c(O)cc1C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.74
InChIKey:PBAKKBHBTISFBZ-UHFFFAOYSA-N
ID: 83314
SMILES:OC(Cc1cc2c(c(O)c1)C1CC(C)(O)CCC1C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -16.581
InChIKey:MCUYPQCGRIHTCI-UHFFFAOYSA-N
ID: 83315
SMILES:C(OC(=O)C(C)(O)C(O)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)CC21)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.519
CB1 binding score: -15.004
InChIKey:KUHKRZAXGXKPBB-UHFFFAOYSA-N
ID: 83316
SMILES:C(Oc1c(O)c(CCCCC)c2c(c1)OC(C)(C)C1CC=C(C)CC12)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.993
InChIKey:AEKXBDCVABGJDQ-UHFFFAOYSA-N
ID: 83317
SMILES:C1(c2c(O)c(C3C(C(CO)=C)CCC(C)=C3)c(O)cc2)CC(C)(C)OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.941
InChIKey:NPCCMYOUOQYWRS-UHFFFAOYSA-N
ID: 83318
SMILES:CC(=CCCC(C)=CCCC(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1OC)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -17.892
InChIKey:YMOPWTOOBMUWAW-UHFFFAOYSA-N
ID: 83319
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(=C)C21)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -12.884
InChIKey:HFXHLGVUHJOGDD-UHFFFAOYSA-N
ID: 83320
SMILES:C1(C)=CCCC(=C)C2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCCO)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.947
InChIKey:IWENVULHMNLOGJ-UHFFFAOYSA-N
ID: 83321
SMILES:CC1(O)CCC(=C(C)C)CC2c3c(cc(CCCCC)cc3O)OC2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.108
InChIKey:IXVSCOKSRFCXSU-UHFFFAOYSA-N
ID: 83322
SMILES:C(O)C1=CC2c3c(O)cc(CCC)cc3OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -17.858
InChIKey:RYAKSGPZEJLWBM-UHFFFAOYSA-N
ID: 83323
SMILES:c1cccc(C(=O)C23C(C(C)(C)OC2=C)CC(CC=C(C)CCCC(C)=C)=C3C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.594
CB1 binding score: -16.362
InChIKey:CPKNTFPKWQNXPQ-UHFFFAOYSA-N
ID: 83324
SMILES:c1c(CCCCCCCCC)cc(O)c2c(O)c(CC=C(CCC=C(C)C)C)c(OC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.679
CB1 binding score: -13.068
InChIKey:VVTXXBOABYFMKE-UHFFFAOYSA-N
ID: 83325
SMILES:O(C)c1c(CCCCC)cc(O)c2c1OC(C)(C)C1CCC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.782
InChIKey:HTQGUYWGSZWAQM-UHFFFAOYSA-N
ID: 83326
SMILES:O1c2c(cc(OC)c(Cc3cc(O)c4c(c3)OC(C)(C)C3CCC(CO)=CC34)c2O)CC1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.601
CB1 binding score: -16.751
InChIKey:OXKUQSDRXKDSBY-UHFFFAOYSA-N
ID: 83327
SMILES:C1C(C)C(O)C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.898
InChIKey:SUVXTOCRTNYFMQ-UHFFFAOYSA-N
ID: 83328
SMILES:O1c2c(c(O)cc(CC)c2)C2C1(C)C1CCC(OC(=O)C)C(C)(C)C1=CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -17.098
InChIKey:RVTKRNSQUMJXAG-UHFFFAOYSA-N