ID: 108571
SMILES:C(C1C(C)=CCC2C(C)(C)CCCC12C)CC1(C)C=Cc2c(OC)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.734
CB1 binding score: -13.305
InChIKey:KLIUTGKZGSHWDD-UHFFFAOYSA-N
ID: 108572
SMILES:Clc1ccc(OCOc2c3c(ccc2)OC(C)(C)C2C3C3C(C)(CC2)C(Br)CCC3(C)O)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 579.959
CB1 binding score: -16.43
InChIKey:TWDVZOCHAWHJFS-UHFFFAOYSA-N
ID: 108573
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 108574
SMILES:C1C(C)C2=C(O1)CC(C(C)=C)CC(Oc1ccc(CCCCC)cc1)(C)CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.59
InChIKey:OIQVTQUFDJXRPZ-UHFFFAOYSA-N
ID: 108575
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCCCO)cc1OC(C)=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.288
InChIKey:BZGVCHHWIABFJR-UHFFFAOYSA-N
ID: 108576
SMILES:O=C(C=Cc1ccc2c(c1)OC(C)(C)C1C(O)CC(C)=CC12)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -13.019
InChIKey:SDLMJHIDHXDXFV-UHFFFAOYSA-N
ID: 108577
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 108578
SMILES:C(=C(C)C)CCC(=CCCC1(C)C=Cc2c(OC)cc(CCCCCC)cc2O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -16.163
InChIKey:VBEUCUROOHLLMX-UHFFFAOYSA-N
ID: 108579
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(CC1)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.12
InChIKey:JRHCAUFVRBOBHN-UHFFFAOYSA-N
ID: 108580
SMILES:CC1(C)C2C(c3c(O)c(CC(=O)C)c(O)c(C=O)c3O1)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -14.88
InChIKey:DCMSKKPBTYTIED-UHFFFAOYSA-N
ID: 108581
SMILES:C12(Br)C(O)C(Cl)=C3C1=C(C(Cl)C(C)(C)C3=O)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.081
CB1 binding score: -15.827
InChIKey:ITZJGRBTPSOKMK-UHFFFAOYSA-N
ID: 108582
SMILES:C(CCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(OC)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -18.773
InChIKey:YBKJMWKLIGSBGR-UHFFFAOYSA-N
ID: 108583
SMILES:C(C(O)=O)(C1CC=C(C)CC1c1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -13.542
InChIKey:CHDLFLXKEYYHJI-UHFFFAOYSA-N
ID: 108584
SMILES:COc1cc(CCCCC)cc2c1C1C=C(C)CC(C)(C)C1CCC2CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -11.734
InChIKey:IVLYLTDNNPWMQN-UHFFFAOYSA-N
ID: 108585
SMILES:O1c2c(c(O)cc(CCCC)c2)C2C=C(CCC3C(C)(O)CCC(C2(C)C)O3)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -17.32
InChIKey:JNMHYVHCUCHUEJ-UHFFFAOYSA-N
ID: 108586
SMILES:C1(=O)CCC2(C)Oc3cc(CCCCC)cc(O)c3C2C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.998
InChIKey:AHXWCPFDAAMGBH-UHFFFAOYSA-N
ID: 108587
SMILES:OC(C(CC(=O)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.67
InChIKey:CPNPZWMFUUTSIP-UHFFFAOYSA-N
ID: 108588
SMILES:C1(O)C2c3c(O)cc(CCCCC)cc3OC(C)(C)C1C(O)CC2(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -12.698
InChIKey:PIQSBLVTKGXKOR-UHFFFAOYSA-N
ID: 108589
SMILES:O(C)C1(CC=C(C)C)C(C)(C)C(Cc2c(O)cc(O)cc2CCCCC)Cc2ccccc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: -12.639
InChIKey:CJUPUZVUDPULHX-UHFFFAOYSA-N
ID: 108590
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 108591
SMILES:C(CCC1(C)C=Cc2c(O)cc(CCCCC)cc2O1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N