ID: 56491
SMILES:C(Cc1c2c(cc(C(O)=O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.897
InChIKey:MYDQFLSHZDXUKB-UHFFFAOYSA-N
ID: 56492
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCCO)c2)-c2cc(C)ccc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.031
InChIKey:MSIHCQAPVYVMLV-UHFFFAOYSA-N
ID: 56493
SMILES:C12C(C)(CCC=C(C)C)Oc3cc(C)cc(O)c3C1C(C)(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 330.468
CB1 binding score: -17.815
InChIKey:OWOHQMZHBNVZQZ-UHFFFAOYSA-N
ID: 56494
SMILES:COc1cc(CCCCC)cc2c1C1C(C(O)C=C(CO)C1)C(C(=O)CC=C(C)C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -17.401
InChIKey:SHUIPKBFBNZGLH-UHFFFAOYSA-N
ID: 56495
SMILES:C1CC2C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c3C2CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.502
CB1 binding score: -17.412
InChIKey:XVJQRVZNXSHVIF-UHFFFAOYSA-N
ID: 56496
SMILES:c1(O)cc(CCc2cc(O)cc(O)c2)cc(O)c1CC=C(C)CCC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -18.243
InChIKey:BEQKQOZTJNDTPG-UHFFFAOYSA-N
ID: 56497
SMILES:C(C=C(C)C)CC(=CCc1c(O)cc(CCCCCO)c(C(=O)O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 376.493
CB1 binding score: -17.149
InChIKey:CWJIQNZUMIRTGY-UHFFFAOYSA-N
ID: 56498
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 56499
SMILES:C12Cc3c(O)cc(CCCCC)cc3OC1(C)CCC1C(C)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.513
InChIKey:AZIKMVNCPVVUFJ-UHFFFAOYSA-N
ID: 56500
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC12)NCc1cnccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.542
CB1 binding score: -15.511
InChIKey:UIUFHCZHVMDTSE-UHFFFAOYSA-N
ID: 56501
SMILES:C(Cc1cc(OC)c2c(c1)OC(C)(C)C1=C2C(O)(C)C(=O)C1=O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -15.953
InChIKey:UETVGHFDLOOYRD-UHFFFAOYSA-N
ID: 56502
SMILES:C(C)(C(=CC)C=CC(OC)c1c2c(c(OC)c(O)c1)C=CC(CCC=C(C)CCC=C(C)C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.716
CB1 binding score: -15.799
InChIKey:MDARIOIMHRSADU-UHFFFAOYSA-N
ID: 56503
SMILES:C1CC(C)=CC(c2c(OC)cccc2)CC1(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.438
InChIKey:GZFHUTGPZSAOPQ-UHFFFAOYSA-N
ID: 56504
SMILES:c1(O)cc(CCCCC)c(O)c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.349
InChIKey:PVWKYDHSQZSCHQ-UHFFFAOYSA-N
ID: 56505
SMILES:OC1C(O)(c2c(O)cc(CCCCC)cc2O)OC(CCC=C(C)C)(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -11.29
InChIKey:AEIVPAVOQMZETF-UHFFFAOYSA-N
ID: 56506
SMILES:C1CC(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 56507
SMILES:C(CC(CC)C)C(c1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -13.36
InChIKey:JQEVVFFTHBEPBX-UHFFFAOYSA-N
ID: 56508
SMILES:C(CCCCCCC(C)C)CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.712
CB1 binding score: -17.119
InChIKey:ABTRUKUWRBRUQT-UHFFFAOYSA-N
ID: 56509
SMILES:C1C(C)=CCCC(=C)CCC2C(C)(C)Oc3cc(CCCCC)c(C(O)=O)c(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -16.014
InChIKey:YMEIESHZGGYIHX-UHFFFAOYSA-N
ID: 56510
SMILES:C1CC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 56511
SMILES:C(CCC)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.879
InChIKey:HZOAQGALRROBTF-UHFFFAOYSA-N