ID: 135997
SMILES:C1(C)C2(O)CCc3c(O)cc(CCCCC)cc3OC2(C)CCC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.38
InChIKey:UMRSGODNYMVBTR-UHFFFAOYSA-N
ID: 135998
SMILES:CC(C)C1C(c2cc(CCCCC)cc(O)c2)(O)CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -14.214
InChIKey:ITVIFJJXYYXHPZ-UHFFFAOYSA-N
ID: 135999
SMILES:CC(=CC1CC(C)C2C(C(C)(O)CC2)C1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.43
InChIKey:CBIDREPFRVVVIY-UHFFFAOYSA-N
ID: 136000
SMILES:C1(=O)C2=C(C(O)C3C1C(C)(C)Oc1cc(CCCCC)cc(O)c13)C(=O)CCC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -13.535
InChIKey:JCJMYDLNRKVHKO-UHFFFAOYSA-N
ID: 136001
SMILES:C(=O)C(CC(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.239
InChIKey:OYTRFRBIAPIOSS-UHFFFAOYSA-N
ID: 136002
SMILES:c1(C)c(Br)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 337.257
CB1 binding score: -16.909
InChIKey:RYMLHYMKISHZSH-UHFFFAOYSA-N
ID: 136003
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C(O)C(C(C)=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.02
InChIKey:BLMCYNMRMBUXLO-UHFFFAOYSA-N
ID: 136004
SMILES:c12c(O)c(C3(C)C(C)(C)C=CC3)cc(C(C(C)C)C)c1COc1cc(CCCCC)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -15.529
InChIKey:UFCHLJVQFOGKRA-UHFFFAOYSA-N
ID: 136005
SMILES:C1C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 136006
SMILES:C(CCc1cc2c(c(O)c1)C1C(CC=C(CCC=C(C)C)C1)C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -18.748
InChIKey:MSFQJCWLUOJTPP-UHFFFAOYSA-N
ID: 136007
SMILES:C(CC)CCc1cc(O)c(C2CC(C)=CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 136008
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 136009
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 136010
SMILES:C(C)(=CCc1c(O)cc(CCCCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 136011
SMILES:C(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 136012
SMILES:C12=Cc3c(O)cc(CCCC(=O)OC)cc3OC(C)(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.011
InChIKey:GXRHFBFLJMIISZ-UHFFFAOYSA-N
ID: 136013
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(CO)C(=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.174
InChIKey:CJRHYYRYCGLADH-UHFFFAOYSA-N
ID: 136014
SMILES:CC1=CCC2C(C)(C)Oc3c2c(c(CCCC(=O)C)c(C)c3O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.252
InChIKey:HAYMCXRRKWAGKS-UHFFFAOYSA-N
ID: 136015
SMILES:C(CCCC)c1cc2c(c(O)c1)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 136016
SMILES:Oc1cc(C(C(C)CC)=O)c(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.913
InChIKey:RVMGTNGTRLGABR-UHFFFAOYSA-N
ID: 136017
SMILES:C1C(=O)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -18.771
InChIKey:VGSHJKOXKGYENI-UHFFFAOYSA-N