ID: 57604
SMILES:C1(C(C)(O)C)Cc2c(O)c(C(=O)O)c(CCCCC)cc2OC1(C=CC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -16.305
InChIKey:OSVQMCIDBFONAL-UHFFFAOYSA-N
ID: 57605
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 57606
SMILES:C1(O)CCC2C(=O)C(c3c(O)cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -16.854
InChIKey:CYIMVCTYIQWQJJ-UHFFFAOYSA-N
ID: 57607
SMILES:c1ccc(OC)c(C2C(C(=C)C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.382
InChIKey:PIWOIVDTYQHIGV-UHFFFAOYSA-N
ID: 57608
SMILES:Oc1cc(CCCCC)cc2c1C1CC(CO)CCC1C(O)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.287
InChIKey:VXFMZRIJUSSIAG-UHFFFAOYSA-N
ID: 57609
SMILES:O=C(O)Cc1c(O)cc2c3c1OC(C)(C)C1C3C(CCC1C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.17
InChIKey:UPLAZHPBNDTLDV-UHFFFAOYSA-N
ID: 57610
SMILES:c1(CCCCC)cc2c(c(O)c1C(=O)OCC1OC(C)C(O)C(O)C1O)C=CC(C=C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.539
CB1 binding score: -12.737
InChIKey:XVWPGZLIUKFERD-UHFFFAOYSA-N
ID: 57611
SMILES:C(CCCCCc1cc2c(c(O)c1)C1C(C(C)(O)CCC1C(C)=C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.816
InChIKey:QGUOTSZGSQQVRD-UHFFFAOYSA-N
ID: 57612
SMILES:C(COC(c1c2c(c(O)c(OC)c1)OC(C)(C)C1C2C=C(C)CC1)=O)CCCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -14.885
InChIKey:LWGXYBBABDBYLC-UHFFFAOYSA-N
ID: 57613
SMILES:C(CO)=Cc1c(O)c2c(c(O)c1C)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.333
InChIKey:RZKZXGQSZXYPTH-UHFFFAOYSA-N
ID: 57614
SMILES:O=C(CCCCC)c1cc2c(cc1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.923
InChIKey:BHACTHAYFQMSBH-UHFFFAOYSA-N
ID: 57615
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 57616
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 57617
SMILES:Oc1c2c(c(C(O)=O)c(CCCCC)c1)OC(C)(C)C1C2C=C(C(OC)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -14.322
InChIKey:OIZUGYKODOJSTM-UHFFFAOYSA-N
ID: 57618
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)cc1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.356
CB1 binding score: -17.555
InChIKey:QUYCDNSZSMEFBQ-UHFFFAOYSA-N
ID: 57619
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 57620
SMILES:C(CC)Cc1cc(O)c2c(c1)C1C=C(CO)CCC1C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.049
InChIKey:KFEMDEYYYBFRQG-UHFFFAOYSA-N
ID: 57621
SMILES:C1(C)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 57622
SMILES:CC1(C)Oc2cc(CCCCCC)cc(O)c2C2C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 57623
SMILES:c1(O)cc(CCCCC)cc2c1C1CC(C)CCC1C(C)CC(C=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -14.452
InChIKey:LPJMVJROHZQHDG-UHFFFAOYSA-N
ID: 57624
SMILES:C(OC(c1c(O)c2c(c(C(CCc3ccccc3)=O)c1O)OC(C)(C)C1CC=C(C)CC21)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.558
CB1 binding score: -14.041
InChIKey:UEINPFFYCFWZKP-UHFFFAOYSA-N