ID: 50842
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 50843
SMILES:C1(=CC2C(C(=C)C)CC(O)C(C)=C2)CCc2c(O)cc(C)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -14.416
InChIKey:REBRHBNZMLCANO-UHFFFAOYSA-N
ID: 50844
SMILES:OC(c1c(O)c2c(cc1C)OC(C)(CCC=C(C)C)C=C2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.624
InChIKey:KVUSKYWXPSGNBG-UHFFFAOYSA-N
ID: 50845
SMILES:C(CCC)CCc1cc(O)c(C2C=C(C)CCC2C(CCC=C(C)CCC=C(C)C)O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.723
CB1 binding score: -13.522
InChIKey:AAAZZJZZWXUYLT-UHFFFAOYSA-N
ID: 50846
SMILES:CC(=CCCC(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 50847
SMILES:CC1(CCC=C(C)CO)C=Cc2cc(CCCCC)cc(O)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.813
InChIKey:LSARTHGYPRKEPU-UHFFFAOYSA-N
ID: 50848
SMILES:C1=C(C(O)=O)C23C(=O)c4c(O)cc(CCCCC)cc4OC2(C)C=C(C)C1(C(C)=C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.521
CB1 binding score: -16.26
InChIKey:FVFYUSMDOOABGV-UHFFFAOYSA-N
ID: 50849
SMILES:CC(=CCc1cc(O)cc(CCCCC)c1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.009
InChIKey:XKWLUCZAWFMDAL-UHFFFAOYSA-N
ID: 50850
SMILES:C1(C)CCC(C(C)C)C(c2cc(CCCCC)ccc2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.503
CB1 binding score: -18.434
InChIKey:FHTXWJYHYWKJKG-UHFFFAOYSA-N
ID: 50851
SMILES:CC(C=CCC(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.527
InChIKey:DKLGIXVZHXBKJB-UHFFFAOYSA-N
ID: 50852
SMILES:C(C1C(C(O)=O)=CCC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.815
InChIKey:XCEJUKHBXNAFEN-UHFFFAOYSA-N
ID: 50853
SMILES:C(CO)(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(OO)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.612
InChIKey:CQVBZALYXSVFPV-UHFFFAOYSA-N
ID: 50854
SMILES:O1c2cc(CCCCC)cc(O)c2C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 50855
SMILES:C1C=C(C)CC2C(C(C)(C)Oc3ccc(cc3)C=C2)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.465
CB1 binding score: -15.514
InChIKey:XAJKOPYFJUDABA-UHFFFAOYSA-N
ID: 50856
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c31)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: Not available
InChIKey:UNEDZJOZALCQCL-UHFFFAOYSA-N
ID: 50857
SMILES:C1OC2C(c3c(O)cc(CCCCC)cc3O)C3OC(C)(CCC3C(C)=C)C=C2C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -13.325
InChIKey:NTTMNJICOPUQPL-UHFFFAOYSA-N
ID: 50858
SMILES:C1C=C(C)CC2C1C(C)(C)Oc1cc(CCCCCOC)cc(OC3OC(CO)C(O)C(O)C3O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.636
CB1 binding score: -15.404
InChIKey:KGNQBOQQADZHIU-UHFFFAOYSA-N
ID: 50859
SMILES:C1=C(C)CCC=C(C)CCC(Cl)C(C)(C)Oc2cc(O)c(C(=O)CC(C)C)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 435.004
CB1 binding score: -13.748
InChIKey:CPTZYDBPOGAJEV-UHFFFAOYSA-N
ID: 50860
SMILES:O1c2cc(CCCCC)cc(O)c2C2C3(CO)OC(C(C)(O)C)CC4C(C)CCC1C43O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -15.272
InChIKey:QUNLLRPCGHHJJA-UHFFFAOYSA-N
ID: 50861
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(CCC=C(CCC=C(C)C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -19.601
InChIKey:JXEWSPILIYHMCP-UHFFFAOYSA-N
ID: 50862
SMILES:C(C)(C)=CCCC1(C)Oc2c(c(O)cc(C(C)O)c2)C(OC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: Not available
InChIKey:ZHIXVTVHKSUQCN-UHFFFAOYSA-N