ID: 88537
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C=C(C=CC2(O)C(C)(C)CC(=O)C=C2C)C(=O)OC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.59
CB1 binding score: -15.62
InChIKey:DOIOOFDFVNJZAC-UHFFFAOYSA-N
ID: 88538
SMILES:C(C)(C)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.137
InChIKey:RGGRIJLFZDXMPM-UHFFFAOYSA-N
ID: 88539
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 88540
SMILES:C(CCCc1cc(O)c2c(c1O)C=CC(CCC=C(C)C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.339
InChIKey:DPWWYSVEFIPIFU-UHFFFAOYSA-N
ID: 88541
SMILES:C(O)C1=CC(c2c(O)cc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.742
InChIKey:VNRLFKGINFBEHO-UHFFFAOYSA-N
ID: 88542
SMILES:C(C)CCc1cc2c(c(O)c1)C1C3C(C)(CCC1C(C)(C)O2)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.545
InChIKey:JDWQITNQFSNZOK-UHFFFAOYSA-N
ID: 88543
SMILES:C1(=O)OC(C(=CCCC(C)=CCc2cc(O)cc(C)c2O)C)CC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.818
InChIKey:XMTDFFWXFXRNSF-UHFFFAOYSA-N
ID: 88544
SMILES:C(C)(C=CCC(C)=CCCC1(C)Oc2c(C)cc(OC)cc2C=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.374
InChIKey:DYQRQYYFQIHDQN-UHFFFAOYSA-N
ID: 88545
SMILES:C1(C2=CC(c3c(O)cc(CCCC)cc3)OC2C=C(CCC=C(C)C)C)C(=O)C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.728
CB1 binding score: -15.288
InChIKey:SIMANKWPTDSBOC-UHFFFAOYSA-N
ID: 88546
SMILES:c1(CCCCC)cc2c(c(O)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 88547
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)c(C(=O)CC(C)C)c(O)c(C=O)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 372.461
CB1 binding score: -17.581
InChIKey:JFADHCMLMYPJCV-UHFFFAOYSA-N
ID: 88548
SMILES:C(C)CCCc1c(C(=O)O)c(O)c2c(c1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.769
InChIKey:GEFZXMXBDJTYLI-UHFFFAOYSA-N
ID: 88549
SMILES:C(C=C(C)C)CC(C)=CCc1c(C)cc2c(c1O)C1=C(C(C)(C)O2)CCC(C)(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -16.108
InChIKey:OMNDGVPDBBCHCI-UHFFFAOYSA-N
ID: 88550
SMILES:C(Cc1cc2c(c(O)c1)-c1c(ccc(C)c1)C(C)(C)O2)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.448
CB1 binding score: -15.217
InChIKey:SDLYFGPCFFSBPO-UHFFFAOYSA-N
ID: 88551
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C(C(O)(C)C)C(C)(C)C1CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.042
InChIKey:QMGBXSDQXIIRQB-UHFFFAOYSA-N
ID: 88552
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 88553
SMILES:C(CCCC)c1ccc2c(c1O)OC(C)(C)C1C2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -15.929
InChIKey:KMGWYGOQEDFOBE-UHFFFAOYSA-N
ID: 88554
SMILES:C(C)OC(c1c2c(c(O)c(CC=C(C)CCC=C(CO)C)c1)OC(C)(C)C1CC=C(C)CC21)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -14.643
InChIKey:IJZCPOKKQIKAJC-UHFFFAOYSA-N
ID: 88555
SMILES:c1c(OC)c(C)cc2c1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -18.805
InChIKey:FPNAYBZLIGJJAV-UHFFFAOYSA-N
ID: 88556
SMILES:OC1c2c(cc(CCCCC)cc2O)OC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.442
InChIKey:FRBSLGKYEBNHLH-UHFFFAOYSA-N
ID: 88557
SMILES:CC1(CCCC(=C)C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.693
InChIKey:WSEYAJSVUKANLY-UHFFFAOYSA-N